Zukerman-Schpector, J. and Caracelli, I. and Stefani, H.A. and Gozhina, O. and Tiekink, E.R.T. (2015) Crystal structure of 2-(3-bromophenyl)-1,3-dithiane. Acta Crystallographica Section E: Crystallographic Communications, 71 (3). o179-o180. ISSN 2056-9890, DOI https://doi.org/10.1107/S2056989015002832.
Full text not available from this repository.Abstract
In the title compound, C10H11BrS2, the 1,3-dithiane ring has a chair conformation with the 1,4-disposed C atoms being above and below the remaining four atoms. The bromobenzene ring occupies an equatorial position and forms a dihedral angle of 86.38 (12)° with the least-squares plane through the 1,3-dithiane ring. Thus, to a first approximation the molecule has mirror symmetry with the mirror containing the bromobenzene ring and the 1,4-disposed C atoms of the 1,3-dithiane ring. In the crystal, molecules associate via weak methylene-bromobenzene C - H⋯π and π-π [Cg⋯ Cg = 3.7770 (14) Å for centrosymmetrically related bromobenzene rings] interactions, forming supramolecular layers parallel to [101]; these stack with no specific intermolecular interactions between them.
| Item Type: | Article |
|---|---|
| Funders: | UNSPECIFIED |
| Uncontrolled Keywords: | Crystal structure; 1,3-dithiane; Conformation; C-H...[pi] interactions; [pi]-[pi] interactions |
| Subjects: | Q Science > Q Science (General) Q Science > QD Chemistry |
| Divisions: | Faculty of Science > Department of Chemistry |
| Depositing User: | Ms. Juhaida Abd Rahim |
| Date Deposited: | 18 Sep 2018 08:25 |
| Last Modified: | 18 Sep 2018 08:25 |
| URI: | http://eprints.um.edu.my/id/eprint/19259 |
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